Products for Research Use Only
RegisterLogin

(S) -IDO1-IN-5

CAT: 0931-T12801-01Size: 2 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T12801-01Size:2 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
2166616-76-6
Target
Indoleamine 2,3-Dioxygenase (IDO), IDO, Others
Related Pathways
Metabolism, Others
Bioactivity
(S) -IDO1-IN-5 is an active S-isomer of IDO1-IN-5. (S) -IDO1-IN-5 binds to IDOL (IC50 value less than 1.5 μΜ) .
Smiles
C[C@H](NC(=O)c1ccc(F)cc1)c1ccc2N(CCc2c1)C(=O)C1CCOCC1
Molecular Formula
C23H25FN2O3
Molecular Weight
396.45
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(S)-Ido1-IN-5
CAS Number2166616-76-6
PubChem CID132209650
IUPAC Name4-fluoro-N-[(1S)-1-[1-(oxane-4-carbonyl)-2,3-dihydroindol-5-yl]ethyl]benzamide
Molecular FormulaC23H25FN2O3
Molecular Weight396.5
XLogP2.9
Topological Polar Surface Area58.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count29
Formal Charge0
Complexity587
SMILES
C[C@@H](C1=CC2=C(C=C1)N(CC2)C(=O)C3CCOCC3)NC(=O)C4=CC=C(C=C4)F
InChI
InChI=1S/C23H25FN2O3/c1-15(25-22(27)16-2-5-20(24)6-3-16)18-4-7-21-19(14-18)8-11-26(21)23(28)17-9-12-29-13-10-17/h2-7,14-15,17H,8-13H2,1H3,(H,25,27)/t15-/m0/s1
InChIKey
NUBWFWVVKLRSHS-HNNXBMFYSA-N
Chemical Structure
2D Structure
2D structure of (S)-Ido1-IN-5
CAS: 2166616-76-6
CID: 132209650
Formula: C23H25FN2O3
MW: 396.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight396.5
XLogP32.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass396.18492083
Monoisotopic Mass396.18492083
Topological Polar Surface Area58.6 Ų
Heavy Atom Count29
Formal Charge0
Complexity587
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
T12668-01(Rac) -IDO1-IN-5
T39888IDO1-IN-7
T39839IDO1-IN-11
T62638-01IDO1-IN-18
T63082-01IDO1-IN-19
T63780-01IDO1-IN-16
T209619-01IDO1-IN-24
T78687-01IDO1-IN-21
T73111-01IDO1-IN-17
T39946IDO1-IN-12

Alternative Products

CatalogName
M22853-01IDO1-IN-5
MBS5753794(Rac)-IDO1-IN-5
GTR19204981-01(Rac) -IDO1-IN-5
GTR19204882-01(S) -IDO1-IN-5
MBS5753851(S)-IDO1-IN-5
551699IDO1
bs-15493R-Cy5.5IDO1 Polyclonal Antibody, Cy5.5 Conjugated
BA6611-5.1IDO1-IN-19
BA7840-1IDO1-IN-18
HY-178954IDO1-IN-32

Popular Products